Bonding of the chain structure for novel boranes B_(3k+)H_(5k+p+3)^-

作     者：ZHONG, Shi-Jun WANG, Yin-Gui ZHANG, Qian-ErState Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Science, Fuzhou, Fujian 350002, China.Department of Chemistry, and Institute of Physical Chemistry, Xiamen University, Xiamen, Fujian 361005, China 

出 版 物：《Chinese Journal of Chemistry》 (中国化学（英文版）)

年 卷 期：1994年第12卷第4期

页      面：289-294页

核心收录：

学科分类：081704[工学-应用化学] 07[理学] 08[工学] 0817[工学-化学工程与技术] 070303[理学-有机化学] 0703[理学-化学] 

基　　金：Project supported financially by the National Natural Science Foundation of China 

主　　题：Symmetrized valence bond function bridge bond novel boranes. 

摘      要：The molecular orbitals obtained from conventional quantum chemistry calculations, are expressed in terms of symmetrized valence bond functions of fragment, and a direct picture of chemical bonding can be drawn easily. This method is utilized, together with extended Huckel calculations, to interpret the bonding properties of a centipede-like chain structure for novel laser-producing boranes B3k+pH5k+p+3- which is constructed from the repeated unit B3H5 linked to each other by three B-H-B bonds.